(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)acrylic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C=CC3=CN(N=C3)CC4=CC=CC=C4)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)/C=C/C3=CN(N=C3)CC4=CC=CC=C4)O

InChI

InChI=1S/C24H20N2O5/c1-16-21(27)9-8-20-19(11-23(29)31-24(16)20)15-30-22(28)10-7-18-12-25-26(14-18)13-17-5-3-2-4-6-17/h2-12,14,27H,13,15H2,1H3/b10-7+